SCHEMBL1666196

SCHEMBL1666196

CC(C)c1nc2cc(O)ccc2c(=O)n1-c1cnc(Cl)nc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.63
ESR1 P03372 4/20 0.52
ESR2 Q92731 4/20 0.52
KMT2A Q03164 2/20 0.38
KCNH2 Q12809 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38
AKR1B1 P15121 1/20 0.37
HSD17B10 Q99714 1/20 0.36
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
PIK3CD O00329 2/20 0.33
PIK3CG P48736 2/20 0.33
PIK3R2 O00459 1/20 0.33
PIK3R1 P27986 1/20 0.33
PIK3CA P42336 1/20 0.33
PIK3CB P42338 1/20 0.33
CRBN Q96SW2 1/20 0.33
GAA P10253 2/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1664314 0.88 TRPV1 (0.64) TRPV1ESR1ESR2KMT2AKCNH2
SCHEMBL1663020 0.87 TRPV1 (0.59) TRPV1ESR1ESR2KMT2AKCNH2
SCHEMBL1663887 0.86 TRPV1 (0.58) TRPV1ESR1ESR2KMT2AKCNH2
SCHEMBL1663398 0.85 TRPV1 (0.72) TRPV1ESR1ESR2KMT2AKCNH2
SCHEMBL1663738 0.84 TRPV1 (0.65) TRPV1ESR1ESR2KMT2AKCNH2
SCHEMBL1665679 0.83 TRPV1 (0.55) TRPV1ESR1ESR2KMT2AKCNH2
SCHEMBL1664513 0.83 TRPV1 (0.64) TRPV1ESR1ESR2KMT2AKCNH2
SCHEMBL1663746 0.82 TRPV1 (0.65) TRPV1ESR1ESR2KMT2AKCNH2
SCHEMBL1665294 0.81 TRPV1 (0.70) TRPV1ESR1ESR2KMT2AKCNH2
SCHEMBL1664439 0.81 TRPV1 (0.74) TRPV1ESR1ESR2KCNH2HRH3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2305652-A2 Trisubstituted quinazolinone derivatives as vanilloid antagonists Novartis AG (CH) 2011-04-06 EP disclosed
US-20090082365-A1 Trisubstituted Quinazolinone Derivatives as Vanilloid Antagonists NOVARTIS AG 2009-03-26 US disclosed
CN-101356160-A Trisubstituted quinazolinone derivatives as vanilloid antagonists JANSSEN PHARMACEUTICA NV (CH) 2009-01-28 CN disclosed
EP-1963283-A2 TRISUBSTITUTED QUINAZOLINONE DERIVATIVES AS VANILLOID ANTAGONISTS Novartis AG (CH) 2008-09-03 EP disclosed
WO-2007065662-A2 TRISUBSTITUTED QUINAZOLINONE DERIVATIVES AS VANILLOID ANTAGONISTS NOVARTIS AG (CH) 2007-06-14 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090082365-A1 Trisubstituted Quinazolinone Derivatives as Vanilloid Antagonists TRPV1, TRPV3, TRPV5 TRPV1 1/4885ESR1 1321/4885ESR2 2159/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.